1-[5-(1,3-benzothiazol-2-yl)pentanoylamino]-3-(3-chlorophenyl)thiourea

Systemtic Name: 1-[5-(1,3-benzothiazol-2-yl)pentanoylamino]-3-(3-chlorophenyl)thiourea Openeye Name: 1-[5-(1,3-benzothiazol-2-yl)pentanoylamino]-3-(3-chlorophenyl)thiourea CAS Name: 1-[[5-(1,3-benzothiazol-2-yl)-1-oxopentyl]amino]-3-(3-chlorophenyl)thiourea IUPAC Name: 1-[5-(1,3-benzothiazol-2-yl)pentanoylamino]-3-(3-chlorophenyl)thiourea Traditional Name: 1-[5-(1,3-benzothiazol-2-yl)pentanoylamino]-3-(3-chlorophenyl)thiourea Formula: C19H19ClN4OS2 MolecularWeight: 418.96336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCCC(=O)NNC(=S)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCCC(=O)NNC(=S)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H19ClN4OS2/c20-13-6-5-7-14(12-13)21-19(26)24-23-17(25)10-3-4-11-18-22-15-8-1-2-9-16(15)27-18/h1-2,5-9,12H,3-4,10-11H2,(H,23,25)(H2,21,24,26)