N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-2-chloranyl-5-(2,5-dimethylpyrrol-1-yl)benzamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-2-chloranyl-5-(2,5-dimethylpyrrol-1-yl)benzamide Openeye Name: N-[4-(2-amino-2-oxo-ethyl)thiazol-2-yl]-2-chloro-5-(2,5-dimethylpyrrol-1-yl)benzamide CAS Name: N-[4-(2-amino-2-oxoethyl)-2-thiazolyl]-2-chloro-5-(2,5-dimethyl-1-pyrrolyl)benzamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-2-chloro-5-(2,5-dimethylpyrrol-1-yl)benzamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)thiazol-2-yl]-2-chloro-5-(2,5-dimethylpyrrol-1-yl)benzamide Formula: C18H17ClN4O2S MolecularWeight: 388.87118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC(=C(C=C2)Cl)C(=O)NC3=NC(=CS3)CC(=O)N)C

Isomeric SMILES

CC1=CC=C(N1C2=CC(=C(C=C2)Cl)C(=O)NC3=NC(=CS3)CC(=O)N)C

InChI

InChI=1S/C18H17ClN4O2S/c1-10-3-4-11(2)23(10)13-5-6-15(19)14(8-13)17(25)22-18-21-12(9-26-18)7-16(20)24/h3-6,8-9H,7H2,1-2H3,(H2,20,24)(H,21,22,25)