1-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-3-(4-nitrophenyl)thiourea Openeye Name: 1-(2-morpholino-1,3-benzothiazol-6-yl)-3-(4-nitrophenyl)thiourea CAS Name: 1-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-3-(4-nitrophenyl)thiourea Traditional Name: 1-(2-morpholino-1,3-benzothiazol-6-yl)-3-(4-nitrophenyl)thiourea Formula: C18H17N5O3S2 MolecularWeight: 415.48928

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=S)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=S)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O3S2/c24-23(25)14-4-1-12(2-5-14)19-17(27)20-13-3-6-15-16(11-13)28-18(21-15)22-7-9-26-10-8-22/h1-6,11H,7-10H2,(H2,19,20,27)