5-(4-methylphenyl)-4-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-thieno[2,3-d]pyrimidine

Systemtic Name: 5-(4-methylphenyl)-4-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-thieno[2,3-d]pyrimidine Openeye Name: 4-(1-allylbenzimidazol-2-yl)sulfanyl-5-(p-tolyl)thieno[2,3-d]pyrimidine CAS Name: 5-(4-methylphenyl)-4-[(1-prop-2-enyl-2-benzimidazolyl)thio]thieno[2,3-d]pyrimidine IUPAC Name: 5-(4-methylphenyl)-4-(1-prop-2-enylbenzimidazol-2-yl)sulfanylthieno[2,3-d]pyrimidine Traditional Name: 4-[(1-allylbenzimidazol-2-yl)thio]-5-(p-tolyl)thieno[2,3-d]pyrimidine Formula: C23H18N4S2 MolecularWeight: 414.54582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SC4=NC5=CC=CC=C5N4CC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SC4=NC5=CC=CC=C5N4CC=C

InChI

InChI=1S/C23H18N4S2/c1-3-12-27-19-7-5-4-6-18(19)26-23(27)29-22-20-17(13-28-21(20)24-14-25-22)16-10-8-15(2)9-11-16/h3-11,13-14H,1,12H2,2H3