3-[(4-butylphenyl)amino]-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[(4-butylphenyl)amino]-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: 3-(4-butylanilino)-2-(4-phenylthiazol-2-yl)prop-2-enenitrile CAS Name: 3-(4-butylanilino)-2-(4-phenyl-2-thiazolyl)-2-propenenitrile IUPAC Name: 3-(4-butylanilino)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: 3-(4-butylanilino)-2-(4-phenylthiazol-2-yl)acrylonitrile Formula: C22H21N3S MolecularWeight: 359.48724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C22H21N3S/c1-2-3-7-17-10-12-20(13-11-17)24-15-19(14-23)22-25-21(16-26-22)18-8-5-4-6-9-18/h4-6,8-13,15-16,24H,2-3,7H2,1H3