2-[4-(2-azanylethyl)phenyl]imino-N-[(4-chlorophenyl)methyl]-3-phenethyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[4-(2-azanylethyl)phenyl]imino-N-[(4-chlorophenyl)methyl]-3-phenethyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[4-(2-aminoethyl)phenyl]imino-N-[(4-chlorophenyl)methyl]-3-phenethyl-thiazole-4-carboxamide CAS Name: 2-[4-(2-aminoethyl)phenyl]imino-N-[(4-chlorophenyl)methyl]-3-phenethyl-4-thiazolecarboxamide IUPAC Name: 2-[4-(2-aminoethyl)phenyl]imino-N-[(4-chlorophenyl)methyl]-3-phenethyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[4-(2-aminoethyl)phenyl]imino-N-(4-chlorobenzyl)-3-phenethyl-4-thiazoline-4-carboxamide Formula: C27H27ClN4OS MolecularWeight: 491.04748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=CSC2=NC3=CC=C(C=C3)CCN)C(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=CSC2=NC3=CC=C(C=C3)CCN)C(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H27ClN4OS/c28-23-10-6-22(7-11-23)18-30-26(33)25-19-34-27(31-24-12-8-21(9-13-24)14-16-29)32(25)17-15-20-4-2-1-3-5-20/h1-13,19H,14-18,29H2,(H,30,33)