tert-butyl N-[3-oxidanylidene-3-[[(4-propylphenyl)-thiophen-2-yl-methyl]amino]propyl]carbamate

Systemtic Name: tert-butyl N-[3-oxidanylidene-3-[[(4-propylphenyl)-thiophen-2-yl-methyl]amino]propyl]carbamate Openeye Name: tert-butyl N-[3-oxo-3-[[(4-propylphenyl)-(2-thienyl)methyl]amino]propyl]carbamate CAS Name: N-[3-oxo-3-[[(4-propylphenyl)-thiophen-2-ylmethyl]amino]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-oxo-3-[[(4-propylphenyl)-thiophen-2-ylmethyl]amino]propyl]carbamate Traditional Name: N-[3-keto-3-[[(4-propylphenyl)-(2-thienyl)methyl]amino]propyl]carbamic acid tert-butyl ester Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCNC(=O)OC(C)(C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCNC(=O)OC(C)(C)C

InChI

InChI=1S/C22H30N2O3S/c1-5-7-16-9-11-17(12-10-16)20(18-8-6-15-28-18)24-19(25)13-14-23-21(26)27-22(2,3)4/h6,8-12,15,20H,5,7,13-14H2,1-4H3,(H,23,26)(H,24,25)