3-azanyl-N-[4-methyl-5-[2-[(3-nitrophenyl)amino]pyrimidin-4-yl]-1,3-thiazol-2-yl]propanamide

Systemtic Name: 3-azanyl-N-[4-methyl-5-[2-[(3-nitrophenyl)amino]pyrimidin-4-yl]-1,3-thiazol-2-yl]propanamide Openeye Name: 3-amino-N-[4-methyl-5-[2-(3-nitroanilino)pyrimidin-4-yl]thiazol-2-yl]propanamide CAS Name: 3-amino-N-[4-methyl-5-[2-(3-nitroanilino)-4-pyrimidinyl]-2-thiazolyl]propanamide IUPAC Name: 3-amino-N-[4-methyl-5-[2-(3-nitroanilino)pyrimidin-4-yl]-1,3-thiazol-2-yl]propanamide Traditional Name: 3-amino-N-[4-methyl-5-[2-(3-nitroanilino)pyrimidin-4-yl]thiazol-2-yl]propionamide Formula: C17H17N7O3S MolecularWeight: 399.42698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCN)C2=NC(=NC=C2)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCN)C2=NC(=NC=C2)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N7O3S/c1-10-15(28-17(20-10)23-14(25)5-7-18)13-6-8-19-16(22-13)21-11-3-2-4-12(9-11)24(26)27/h2-4,6,8-9H,5,7,18H2,1H3,(H,19,21,22)(H,20,23,25)