tert-butyl N-[3-[[1-(1-benzothiophen-2-yl)cyclohexyl]amino]-3-oxidanylidene-propyl]carbamate

Systemtic Name: tert-butyl N-[3-[[1-(1-benzothiophen-2-yl)cyclohexyl]amino]-3-oxidanylidene-propyl]carbamate Openeye Name: tert-butyl N-[3-[[1-(benzothiophen-2-yl)cyclohexyl]amino]-3-oxo-propyl]carbamate CAS Name: N-[3-[[1-(1-benzothiophen-2-yl)cyclohexyl]amino]-3-oxopropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[[1-(1-benzothiophen-2-yl)cyclohexyl]amino]-3-oxopropyl]carbamate Traditional Name: N-[3-[[1-(benzothiophen-2-yl)cyclohexyl]amino]-3-keto-propyl]carbamic acid tert-butyl ester Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)NC1(CCCCC1)C2=CC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)NC1(CCCCC1)C2=CC3=CC=CC=C3S2

InChI

InChI=1S/C22H30N2O3S/c1-21(2,3)27-20(26)23-14-11-19(25)24-22(12-7-4-8-13-22)18-15-16-9-5-6-10-17(16)28-18/h5-6,9-10,15H,4,7-8,11-14H2,1-3H3,(H,23,26)(H,24,25)