1-[(3-chloranyl-6-ethyl-1-benzothiophen-2-yl)carbonylamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(3-chloranyl-6-ethyl-1-benzothiophen-2-yl)carbonylamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(3-chloro-6-ethyl-benzothiophene-2-carbonyl)amino]thiourea CAS Name: 1-[[(3-chloro-6-ethyl-1-benzothiophen-2-yl)-oxomethyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(3-chloro-6-ethyl-1-benzothiophene-2-carbonyl)amino]thiourea Traditional Name: 1-benzyl-3-[(3-chloro-6-ethyl-benzothiophene-2-carbonyl)amino]thiourea Formula: C19H18ClN3OS2 MolecularWeight: 403.94872

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=C(S2)C(=O)NNC(=S)NCC3=CC=CC=C3)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=C(S2)C(=O)NNC(=S)NCC3=CC=CC=C3)Cl

InChI

InChI=1S/C19H18ClN3OS2/c1-2-12-8-9-14-15(10-12)26-17(16(14)20)18(24)22-23-19(25)21-11-13-6-4-3-5-7-13/h3-10H,2,11H2,1H3,(H,22,24)(H2,21,23,25)