N-methyl-3-(2-propan-2-ylsulfanyl-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propan-1-amine

Systemtic Name: N-methyl-3-(2-propan-2-ylsulfanyl-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propan-1-amine Openeye Name: 3-(2-isopropylsulfanyl-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N-methyl-propan-1-amine CAS Name: N-methyl-3-[2-(propan-2-ylthio)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]-1-propanamine IUPAC Name: N-methyl-3-(2-propan-2-ylsulfanyl-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propan-1-amine Traditional Name: 3-[2-(isopropylthio)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]propyl-methyl-amine Formula: C21H28N2S MolecularWeight: 340.52542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC2=C(CCC3=CC=CC=C3N2CCCNC)C=C1

Isomeric SMILES

CC(C)SC1=CC2=C(CCC3=CC=CC=C3N2CCCNC)C=C1

InChI

InChI=1S/C21H28N2S/c1-16(2)24-19-12-11-18-10-9-17-7-4-5-8-20(17)23(21(18)15-19)14-6-13-22-3/h4-5,7-8,11-12,15-16,22H,6,9-10,13-14H2,1-3H3