N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3-methoxyphenyl)-5-methyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3-methoxyphenyl)-5-methyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(3-methoxyphenyl)-5-methyl-triazole-4-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3-methoxyphenyl)-5-methyl-4-triazolecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3-methoxyphenyl)-5-methyltriazole-4-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(3-methoxyphenyl)-5-methyl-triazole-4-carboxamide Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC(=CC=C2)OC)C(=O)NC3=C(C4=C(S3)CCCC4)C#N

Isomeric SMILES

CC1=C(N=NN1C2=CC(=CC=C2)OC)C(=O)NC3=C(C4=C(S3)CCCC4)C#N

InChI

InChI=1S/C20H19N5O2S/c1-12-18(23-24-25(12)13-6-5-7-14(10-13)27-2)19(26)22-20-16(11-21)15-8-3-4-9-17(15)28-20/h5-7,10H,3-4,8-9H2,1-2H3,(H,22,26)