1-cyclopropyl-3-[4-[6-(cyclopropylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea

Systemtic Name: 1-cyclopropyl-3-[4-[6-(cyclopropylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea Openeye Name: 1-cyclopropyl-3-[4-[6-(cyclopropylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea CAS Name: 1-cyclopropyl-3-[4-[6-[[(cyclopropylamino)-sulfanylidenemethyl]amino]-1H-benzimidazol-2-yl]phenyl]thiourea IUPAC Name: 1-cyclopropyl-3-[4-[6-(cyclopropylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea Traditional Name: 1-cyclopropyl-3-[4-[6-(cyclopropylthiocarbamoylamino)-1H-benzimidazol-2-yl]phenyl]thiourea Formula: C21H22N6S2 MolecularWeight: 422.56958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)NC(=S)NC5CC5

Isomeric SMILES

C1CC1NC(=S)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)NC(=S)NC5CC5

InChI

InChI=1S/C21H22N6S2/c28-20(23-14-5-6-14)22-13-3-1-12(2-4-13)19-26-17-10-9-16(11-18(17)27-19)25-21(29)24-15-7-8-15/h1-4,9-11,14-15H,5-8H2,(H,26,27)(H2,22,23,28)(H2,24,25,29)