1-(2-ethylphenyl)-3-[(9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-6-yl)carbonylamino]thiourea

Systemtic Name: 1-(2-ethylphenyl)-3-[(9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-6-yl)carbonylamino]thiourea Openeye Name: 1-(2-ethylphenyl)-3-[(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbonyl)amino]thiourea CAS Name: 1-(2-ethylphenyl)-3-[[oxo-(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-6-yl)methyl]amino]thiourea IUPAC Name: 1-(2-ethylphenyl)-3-[(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbonyl)amino]thiourea Traditional Name: 1-(2-ethylphenyl)-3-[(9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbonyl)amino]thiourea Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NNC(=O)C2=CC3=C(C=C2)C(=O)N4CCCC4=N3

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NNC(=O)C2=CC3=C(C=C2)C(=O)N4CCCC4=N3

InChI

InChI=1S/C21H21N5O2S/c1-2-13-6-3-4-7-16(13)23-21(29)25-24-19(27)14-9-10-15-17(12-14)22-18-8-5-11-26(18)20(15)28/h3-4,6-7,9-10,12H,2,5,8,11H2,1H3,(H,24,27)(H2,23,25,29)