N-[4-[1-imidazol-1-yl-4-(5-methylthiophen-2-yl)butan-2-yl]sulfanylphenyl]methanamide

Systemtic Name: N-[4-[1-imidazol-1-yl-4-(5-methylthiophen-2-yl)butan-2-yl]sulfanylphenyl]methanamide Openeye Name: N-[4-[1-(imidazol-1-ylmethyl)-3-(5-methyl-2-thienyl)propyl]sulfanylphenyl]formamide CAS Name: N-[4-[[1-(1-imidazolyl)-4-(5-methyl-2-thiophenyl)butan-2-yl]thio]phenyl]formamide IUPAC Name: N-[4-[1-imidazol-1-yl-4-(5-methylthiophen-2-yl)butan-2-yl]sulfanylphenyl]formamide Traditional Name: N-[4-[[1-(imidazol-1-ylmethyl)-3-(5-methyl-2-thienyl)propyl]thio]phenyl]formamide Formula: C19H21N3OS2 MolecularWeight: 371.51954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CCC(CN2C=CN=C2)SC3=CC=C(C=C3)NC=O

Isomeric SMILES

CC1=CC=C(S1)CCC(CN2C=CN=C2)SC3=CC=C(C=C3)NC=O

InChI

InChI=1S/C19H21N3OS2/c1-15-2-5-17(24-15)8-9-19(12-22-11-10-20-13-22)25-18-6-3-16(4-7-18)21-14-23/h2-7,10-11,13-14,19H,8-9,12H2,1H3,(H,21,23)