N-[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]-2H-benzotriazole-5-carboxamide CAS Name: N-[4-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-thiazolyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[4-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-1,3-thiazol-2-yl]-2H-benzotriazole-5-carboxamide Traditional Name: N-[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]-2H-benzotriazole-5-carboxamide Formula: C19H18N6OS MolecularWeight: 378.45082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)NC(=O)C3=CC4=NNN=C4C=C3

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)NC(=O)C3=CC4=NNN=C4C=C3

InChI

InChI=1S/C19H18N6OS/c1-4-7-25-11(2)8-14(12(25)3)17-10-27-19(20-17)21-18(26)13-5-6-15-16(9-13)23-24-22-15/h4-6,8-10H,1,7H2,2-3H3,(H,20,21,26)(H,22,23,24)