N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanamide

Systemtic Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanamide Openeye Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide CAS Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide IUPAC Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide Traditional Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(3-keto-4H-quinoxalin-2-yl)propionamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCC3=NC4=CC=CC=C4NC3=O

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCC3=NC4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H20N4O2S/c1-12-6-7-13-14(11-22)21(28-18(13)10-12)25-19(26)9-8-17-20(27)24-16-5-3-2-4-15(16)23-17/h2-5,12H,6-10H2,1H3,(H,24,27)(H,25,26)