1-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]-3-phenethyl-thiourea

Systemtic Name: 1-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]-3-phenethyl-thiourea Openeye Name: 1-[(5-nitro-2-oxo-indol-3-yl)amino]-3-phenethyl-thiourea CAS Name: 1-[(5-nitro-2-oxo-3-indolyl)amino]-3-phenethylthiourea IUPAC Name: 1-[(5-nitro-2-oxoindol-3-yl)amino]-3-phenethylthiourea Traditional Name: 1-[(2-keto-5-nitro-indol-3-yl)amino]-3-phenethyl-thiourea Formula: C17H15N5O3S MolecularWeight: 369.3977

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NNC2=C3C=C(C=CC3=NC2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NNC2=C3C=C(C=CC3=NC2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O3S/c23-16-15(13-10-12(22(24)25)6-7-14(13)19-16)20-21-17(26)18-9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H2,18,21,26)(H,19,20,23)