N-[3-methyl-1-oxidanylidene-1-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-methyl-1-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylcarbamoyl]propyl]thiophene-2-carboxamide CAS Name: N-[3-methyl-1-oxo-1-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-methyl-1-[[4-(1,2,4-triazol-1-ylmethyl)benzyl]carbamoyl]propyl]thiophene-2-carboxamide Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=C(C=C1)CN2C=NC=N2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C(C(=O)NCC1=CC=C(C=C1)CN2C=NC=N2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H23N5O2S/c1-14(2)18(24-19(26)17-4-3-9-28-17)20(27)22-10-15-5-7-16(8-6-15)11-25-13-21-12-23-25/h3-9,12-14,18H,10-11H2,1-2H3,(H,22,27)(H,24,26)