1-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]carbonylamino]-3-propyl-thiourea

Systemtic Name: 1-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]carbonylamino]-3-propyl-thiourea Openeye Name: 1-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzoyl]amino]-3-propyl-thiourea CAS Name: 1-[[[4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]phenyl]-oxomethyl]amino]-3-propylthiourea IUPAC Name: 1-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzoyl]amino]-3-propylthiourea Traditional Name: 1-[[4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzoyl]amino]-3-propyl-thiourea Formula: C18H23N5OS2 MolecularWeight: 389.53812

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NNC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCCNC(=S)NNC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C18H23N5OS2/c1-4-9-19-17(25)23-22-16(24)15-7-5-14(6-8-15)11-26-18-20-12(2)10-13(3)21-18/h5-8,10H,4,9,11H2,1-3H3,(H,22,24)(H2,19,23,25)