5-[2-[[4-(aminomethyl)phenyl]amino]pyrimidin-4-yl]-3,4-dimethyl-1,3-thiazol-2-one

Systemtic Name: 5-[2-[[4-(aminomethyl)phenyl]amino]pyrimidin-4-yl]-3,4-dimethyl-1,3-thiazol-2-one Openeye Name: 5-[2-[4-(aminomethyl)anilino]pyrimidin-4-yl]-3,4-dimethyl-thiazol-2-one CAS Name: 5-[2-[4-(aminomethyl)anilino]-4-pyrimidinyl]-3,4-dimethyl-2-thiazolone IUPAC Name: 5-[2-[4-(aminomethyl)anilino]pyrimidin-4-yl]-3,4-dimethyl-1,3-thiazol-2-one Traditional Name: 5-[2-[4-(aminomethyl)anilino]pyrimidin-4-yl]-3,4-dimethyl-4-thiazolin-2-one Formula: C16H17N5OS MolecularWeight: 327.40408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=O)N1C)C2=NC(=NC=C2)NC3=CC=C(C=C3)CN

Isomeric SMILES

CC1=C(SC(=O)N1C)C2=NC(=NC=C2)NC3=CC=C(C=C3)CN

InChI

InChI=1S/C16H17N5OS/c1-10-14(23-16(22)21(10)2)13-7-8-18-15(20-13)19-12-5-3-11(9-17)4-6-12/h3-8H,9,17H2,1-2H3,(H,18,19,20)