[2-[[(6R)-6-tert-butyl-3-[(4-methoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxidanylidene-ethyl]-(2-methylpropyl)azanium

Systemtic Name: [2-[[(6R)-6-tert-butyl-3-[(4-methoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxidanylidene-ethyl]-(2-methylpropyl)azanium Openeye Name: [2-[[(6R)-6-tert-butyl-3-[(4-methoxyphenyl)carbamoyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-oxo-ethyl]-isobutyl-ammonium CAS Name: [2-[[(6R)-6-tert-butyl-3-[(4-methoxyanilino)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethyl]-(2-methylpropyl)ammonium IUPAC Name: [2-[[(6R)-6-tert-butyl-3-[(4-methoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethyl]-(2-methylpropyl)azanium Traditional Name: [2-[[(6R)-6-tert-butyl-3-[(4-methoxyphenyl)carbamoyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-keto-ethyl]-isobutyl-ammonium Formula: C26H38N3O3S+ MolecularWeight: 472.66322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]CC(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)C)C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C[NH2+]CC(=O)NC1=C(C2=C(S1)C[C@@H](CC2)C(C)(C)C)C(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C26H37N3O3S/c1-16(2)14-27-15-22(30)29-25-23(24(31)28-18-8-10-19(32-6)11-9-18)20-12-7-17(26(3,4)5)13-21(20)33-25/h8-11,16-17,27H,7,12-15H2,1-6H3,(H,28,31)(H,29,30)/p+1/t17-/m1/s1