1-(1,3-benzothiazol-2-yl)-3-[2-(5-iodanylthiophen-2-yl)ethyl]thiourea

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(5-iodanylthiophen-2-yl)ethyl]thiourea Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(5-iodo-2-thienyl)ethyl]thiourea CAS Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(5-iodo-2-thiophenyl)ethyl]thiourea IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(5-iodothiophen-2-yl)ethyl]thiourea Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(5-iodo-2-thienyl)ethyl]thiourea Formula: C14H12IN3S3 MolecularWeight: 445.36465

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=S)NCCC3=CC=C(S3)I

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=S)NCCC3=CC=C(S3)I

InChI

InChI=1S/C14H12IN3S3/c15-12-6-5-9(20-12)7-8-16-13(19)18-14-17-10-3-1-2-4-11(10)21-14/h1-6H,7-8H2,(H2,16,17,18,19)