1-(4-bromanyl-2-chloranyl-phenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea Formula: C14H13BrClN3S2 MolecularWeight: 402.76012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=S)NC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=S)NC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C14H13BrClN3S2/c15-8-5-6-10(9(16)7-8)17-13(20)19-14-18-11-3-1-2-4-12(11)21-14/h5-7H,1-4H2,(H2,17,18,19,20)