1-(1,3-benzodioxol-5-yl)-3-[(5-methyl-4-phenyl-thiophen-3-yl)carbonylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[(5-methyl-4-phenyl-thiophen-3-yl)carbonylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[(5-methyl-4-phenyl-thiophene-3-carbonyl)amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[[(5-methyl-4-phenyl-3-thiophenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[(5-methyl-4-phenylthiophene-3-carbonyl)amino]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[(5-methyl-4-phenyl-thiophene-3-carbonyl)amino]thiourea Formula: C20H17N3O3S2 MolecularWeight: 411.49728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CS1)C(=O)NNC(=S)NC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CS1)C(=O)NNC(=S)NC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C20H17N3O3S2/c1-12-18(13-5-3-2-4-6-13)15(10-28-12)19(24)22-23-20(27)21-14-7-8-16-17(9-14)26-11-25-16/h2-10H,11H2,1H3,(H,22,24)(H2,21,23,27)