1-methyl-3-[(2-phenyl-1,3-thiazol-4-yl)methyl]thiourea

Systemtic Name: 1-methyl-3-[(2-phenyl-1,3-thiazol-4-yl)methyl]thiourea Openeye Name: 1-methyl-3-[(2-phenylthiazol-4-yl)methyl]thiourea CAS Name: 1-methyl-3-[(2-phenyl-4-thiazolyl)methyl]thiourea IUPAC Name: 1-methyl-3-[(2-phenyl-1,3-thiazol-4-yl)methyl]thiourea Traditional Name: 1-methyl-3-[(2-phenylthiazol-4-yl)methyl]thiourea Formula: C12H13N3S2 MolecularWeight: 263.38172

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NCC1=CSC(=N1)C2=CC=CC=C2

Isomeric SMILES

CNC(=S)NCC1=CSC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C12H13N3S2/c1-13-12(16)14-7-10-8-17-11(15-10)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H2,13,14,16)