3-(butylamino)-3-[(4-methylphenyl)amino]-1-thiophen-2-yl-prop-2-en-1-one

Systemtic Name: 3-(butylamino)-3-[(4-methylphenyl)amino]-1-thiophen-2-yl-prop-2-en-1-one Openeye Name: 3-(butylamino)-3-(4-methylanilino)-1-(2-thienyl)prop-2-en-1-one CAS Name: 3-(butylamino)-3-(4-methylanilino)-1-thiophen-2-yl-2-propen-1-one IUPAC Name: 3-(butylamino)-3-(4-methylanilino)-1-thiophen-2-ylprop-2-en-1-one Traditional Name: 3-(butylamino)-3-(p-toluidino)-1-(2-thienyl)prop-2-en-1-one Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=CC(=O)C1=CC=CS1)NC2=CC=C(C=C2)C

Isomeric SMILES

CCCCNC(=CC(=O)C1=CC=CS1)NC2=CC=C(C=C2)C

InChI

InChI=1S/C18H22N2OS/c1-3-4-11-19-18(13-16(21)17-6-5-12-22-17)20-15-9-7-14(2)8-10-15/h5-10,12-13,19-20H,3-4,11H2,1-2H3