1-(1-benzothiophen-2-yl)-7,8-diethoxy-5-propyl-3,5-dihydro-2,3-benzodiazepin-4-one

Systemtic Name: 1-(1-benzothiophen-2-yl)-7,8-diethoxy-5-propyl-3,5-dihydro-2,3-benzodiazepin-4-one Openeye Name: 1-(benzothiophen-2-yl)-7,8-diethoxy-5-propyl-3,5-dihydro-2,3-benzodiazepin-4-one CAS Name: 1-(1-benzothiophen-2-yl)-7,8-diethoxy-5-propyl-3,5-dihydro-2,3-benzodiazepin-4-one IUPAC Name: 1-(1-benzothiophen-2-yl)-7,8-diethoxy-5-propyl-3,5-dihydro-2,3-benzodiazepin-4-one Traditional Name: 1-(benzothiophen-2-yl)-7,8-diethoxy-5-propyl-3,5-dihydro-2,3-benzodiazepin-4-one Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C2=CC(=C(C=C2C(=NNC1=O)C3=CC4=CC=CC=C4S3)OCC)OCC

Isomeric SMILES

CCCC1C2=CC(=C(C=C2C(=NNC1=O)C3=CC4=CC=CC=C4S3)OCC)OCC

InChI

InChI=1S/C24H26N2O3S/c1-4-9-16-17-13-19(28-5-2)20(29-6-3)14-18(17)23(25-26-24(16)27)22-12-15-10-7-8-11-21(15)30-22/h7-8,10-14,16H,4-6,9H2,1-3H3,(H,26,27)