N-[1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide

Systemtic Name: N-[1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide Openeye Name: N-[1-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamoyl]-2-methyl-propyl]-3-methyl-benzamide CAS Name: N-[1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide IUPAC Name: N-[1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide Traditional Name: N-[1-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamoyl]-2-methyl-propyl]-3-methyl-benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)NC2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C22H25N3O2S/c1-13(2)19(24-20(26)15-8-6-7-14(3)11-15)21(27)25-22-17(12-23)16-9-4-5-10-18(16)28-22/h6-8,11,13,19H,4-5,9-10H2,1-3H3,(H,24,26)(H,25,27)