N-[4-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methyl-phenyl]amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methyl-phenyl]amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methyl-anilino]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methylanilino]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methylanilino]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methyl-anilino]-4-keto-butyl]thiophene-3-carboxamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCCNC(=O)C2=CSC=C2)C3=NNC(=N3)C4CC4

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCCNC(=O)C2=CSC=C2)C3=NNC(=N3)C4CC4

InChI

InChI=1S/C21H23N5O2S/c1-13-4-7-17(16(11-13)20-24-19(25-26-20)14-5-6-14)23-18(27)3-2-9-22-21(28)15-8-10-29-12-15/h4,7-8,10-12,14H,2-3,5-6,9H2,1H3,(H,22,28)(H,23,27)(H,24,25,26)