1-[(4S)-6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl]-3-(3-nitrophenyl)urea

Systemtic Name: 1-[(4S)-6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl]-3-(3-nitrophenyl)urea Openeye Name: 1-[(4S)-6-chlorothiochroman-4-yl]-3-(3-nitrophenyl)urea CAS Name: 1-[(4S)-6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-3-(3-nitrophenyl)urea IUPAC Name: 1-[(4S)-6-chloro-3,4-dihydro-2H-thiochromen-4-yl]-3-(3-nitrophenyl)urea Traditional Name: 1-[(4S)-6-chlorothiochroman-4-yl]-3-(3-nitrophenyl)urea Formula: C16H14ClN3O3S MolecularWeight: 363.81866

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1NC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C=C(C=C2)Cl

Isomeric SMILES

C1CSC2=C([C@H]1NC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C=C(C=C2)Cl

InChI

InChI=1S/C16H14ClN3O3S/c17-10-4-5-15-13(8-10)14(6-7-24-15)19-16(21)18-11-2-1-3-12(9-11)20(22)23/h1-5,8-9,14H,6-7H2,(H2,18,19,21)/t14-/m0/s1