1-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-ethyl-benzimidazol-5-yl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-ethyl-benzimidazol-5-yl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-ethyl-benzimidazol-5-yl]thiourea CAS Name: 1-[2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-1-ethyl-5-benzimidazolyl]-3-prop-2-enylthiourea IUPAC Name: 1-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-ethylbenzimidazol-5-yl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-1-ethyl-benzimidazol-5-yl]thiourea Formula: C20H24N6S2 MolecularWeight: 412.57476

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=S)NCC=C)N=C1CSC3=NC(=CC(=N3)C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=S)NCC=C)N=C1CSC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C20H24N6S2/c1-5-9-21-19(27)24-15-7-8-17-16(11-15)25-18(26(17)6-2)12-28-20-22-13(3)10-14(4)23-20/h5,7-8,10-11H,1,6,9,12H2,2-4H3,(H2,21,24,27)