6,7,8,9-tetrahydro-5H-carbazol-3-yl-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: 6,7,8,9-tetrahydro-5H-carbazol-3-yl-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: 6,7,8,9-tetrahydro-5H-carbazol-3-yl-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: 6,7,8,9-tetrahydro-5H-carbazol-3-yl-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: 6,7,8,9-tetrahydro-5H-carbazol-3-yl-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: 6,7,8,9-tetrahydro-5H-carbazol-3-yl-[4-(2-thenyl)-1,4-diazepan-1-yl]methanone Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)N4CCCN(CC4)CC5=CC=CS5

Isomeric SMILES

C1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)N4CCCN(CC4)CC5=CC=CS5

InChI

InChI=1S/C23H27N3OS/c27-23(26-11-4-10-25(12-13-26)16-18-5-3-14-28-18)17-8-9-22-20(15-17)19-6-1-2-7-21(19)24-22/h3,5,8-9,14-15,24H,1-2,4,6-7,10-13,16H2